N~2~-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3-cyanophenyl)-N~2~-methylglycinamide
Chemical Structure Depiction of
N~2~-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3-cyanophenyl)-N~2~-methylglycinamide
N~2~-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3-cyanophenyl)-N~2~-methylglycinamide
Compound characteristics
Compound ID: | G938-0927 |
Compound Name: | N~2~-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3-cyanophenyl)-N~2~-methylglycinamide |
Molecular Weight: | 434.86 |
Molecular Formula: | C18 H15 Cl N4 O5 S |
Smiles: | CN(CC(Nc1cccc(C#N)c1)=O)S(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 1.7793 |
logD: | 1.7207 |
logSw: | -3.0816 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 106.278 |
InChI Key: | UTNGLPHKXSCEEA-UHFFFAOYSA-N |